검색결과 : 54건
| No. | Article |
|---|---|
| 1 |
CO2 role on the glycerol conversion over catalyst containing CaO-SiO2 doped with Ag and Pt Costa JDM, Santos RCR, Coutinho LP, Silva OR, Barros HO, Freire VN, Valentini A Catalysis Today, 344, 199, 2020 |
| 2 |
Ribosomal RNA-Aminoglycoside Hygromycin B Interaction Energy Calculation within a Density Functional Theory Framework Bezerra KS, Fulco UL, Esmaile SC, Neto JXL, Machado LD, Freire VN, Albuquerque EL, Oliveira JIN Journal of Physical Chemistry B, 123(30), 6421, 2019 |
| 3 |
Vibrational Properties of Bulk Boric Acid 2A and 3T Polymorphs and Their Two-Dimensional Layers: Measurements and Density Functional Theory Calculations da Silva MB, Santos RCR, Freire PTC, Caetano EWS, Freire VN Journal of Physical Chemistry A, 122(5), 1312, 2018 |
| 4 |
Vibrational Modes and Phonon and Thermodynamic Properties of the Metaboric Acid Polymorphs alpha-, beta-, and gamma-(BOH)(3)O-3 within a Density Functional Theory Framework da Silva MB, Santos RCR, Hernandez JSR, Caetano EWS, Freire VN Journal of Physical Chemistry A, 122(38), 7628, 2018 |
| 5 |
Carbon fiber/epoxy composites: effect of zinc sulphide coated carbon nanotube on thermal and mechanical properties Maron GK, Noremberg BS, Alano JH, Pereira FR, Deon VG, Santos RCR, Freire VN, Valentini A, Carreno NLV Polymer Bulletin, 75(4), 1619, 2018 |
| 6 |
DFT Calculations with van der Waals Interactions of Hydrated Calcium Carbonate Crystals CaCO3 center dot(H2O, 6H(2)O): Structural, Electronic, Optical, and Vibrational Properties Costa SN, Freire VN, Caetano EWS, Maia FF, Barboza CA, Fulco UL, Albuquerque EL Journal of Physical Chemistry A, 120(28), 5752, 2016 |
| 7 |
Elucidating the high-k insulator alpha-Al2O3 direct/indirect energy band gap type through density functional theory computations Santos RCR, Longhinotti E, Freire VN, Reimberg RB, Caetano EWS Chemical Physics Letters, 637, 172, 2015 |
| 8 |
Vibrational Spectroscopy and Phonon-Related Properties of the (L)-Aspartic Acid Anhydrous Monoclinic Crystal Silva AM, Costa SN, Sales FAM, Freire VN, Bezerra EM, Santos RP, Fulco UL, Albuquerque EL, Caetano EWS Journal of Physical Chemistry A, 119(49), 11791, 2015 |
| 9 |
Simple synthesis of Al2O3 sphere composite from hybrid process with improved thermal stability for catalytic applications Santos RCR, Pinheiro AN, Leite ER, Freire VN, Longhinotti E, Valentini A Materials Chemistry and Physics, 160, 119, 2015 |
| 10 |
Exploiting the Reduction of Haloperidol: Electrochemical and Computational Studies Using Silver Amalgam and HMDE Electrodes Ribeiro FWP, Mendonca GLF, Soares JES, Freire VN, De Souza D, Casciano PNS, de Lima-Neto P, Correia AN Electrochimica Acta, 137, 564, 2014 |